8-chloranyl-6-fluoranyl-1-(4-fluoranyl-3-methoxy-phenyl)-7-(methylamino)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-6-fluoranyl-1-(4-fluoranyl-3-methoxy-phenyl)-7-(methylamino)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-chloro-6-fluoro-1-(4-fluoro-3-methoxy-phenyl)-7-(methylamino)-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-chloro-6-fluoro-1-(4-fluoro-3-methoxyphenyl)-7-(methylamino)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-6-fluoro-1-(4-fluoro-3-methoxyphenyl)-7-(methylamino)-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-chloro-6-fluoro-1-(4-fluoro-3-methoxy-phenyl)-4-keto-7-(methylamino)quinoline-3-carboxylic acid Formula: C18H13ClF2N2O4 MolecularWeight: 394.756626

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C2C(=C1Cl)N(C=C(C2=O)C(=O)O)C3=CC(=C(C=C3)F)OC)F

Isomeric SMILES

CNC1=C(C=C2C(=C1Cl)N(C=C(C2=O)C(=O)O)C3=CC(=C(C=C3)F)OC)F

InChI

InChI=1S/C18H13ClF2N2O4/c1-22-15-12(21)6-9-16(14(15)19)23(7-10(17(9)24)18(25)26)8-3-4-11(20)13(5-8)27-2/h3-7,22H,1-2H3,(H,25,26)